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. 2024 Jan 25;29(3):597. doi: 10.3390/molecules29030597

Table 1.

Docking of β-sitosterol, lupeol, sorafenib, and sunitinib to VEGFR2 1 kinase domain.

Compound Binding Residues in Kinase Domain Binding ΔG
Lupeol ALA866, VAL848, LEU840, LEU1035 −8.5
β-sitosterol ALA866, VAL848, LEU840, LEU1035, CYS1045 −7.9
Sorafenib ALA866, VAL848, LEU840, LEU1035, LYS868, ASP1046, CYS919, PHE1047 −8.0
Sunitinib ALA866, VAL848, LEU840, ALA881, GLU885, LEU882, LYS868, GLY846, PHE918 −7.2

1 Vascular endothelial growth factor receptor 2.